rcdklibs: The CDK Libraries Packaged for R

An R interface to the Chemistry Development Kit, a Java library for chemoinformatics. Given the size of the library itself, this package is not expected to change very frequently. To make use of the CDK within R, it is suggested that you use the rcdk package. Note that it is possible to directly interact with the CDK using rJava. However rcdk exposes functionality in a more idiomatic way. The CDK library itself is released as LGPL and the sources can be obtained from https://github.com/cdk/cdk.

Install the latest version of this package by entering the following in R:
install.packages("rcdklibs")
AuthorRajarshi Guha [aut], Zachary Charlop-Powers [cre], CDK Project [ctb, cph] (CDK Java library contained in multiple jar files)
Date of publication2016-05-16 14:32:33
MaintainerZachary Charlop-Powers <zach.charlop.powers@gmail.com>
LicenseLGPL
Version1.5.13

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Functions

rcdklibs Man page

Files

inst
inst/AUTHORS
inst/cont
inst/cont/cdk-1.5.13.jar
NAMESPACE
NEWS
R
R/rcdklibs.R
MD5
java
java/README
DESCRIPTION
man
man/rcdklibs.Rd

Questions? Problems? Suggestions? or email at ian@mutexlabs.com.

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